2-butoxyethanoic acid; N,3-dimethyl-5,6-diphenyl-pyrazin-2-amine

Systemtic Name: 2-butoxyethanoic acid; N,3-dimethyl-5,6-diphenyl-pyrazin-2-amine Openeye Name: 2-butoxyacetic acid; N,3-dimethyl-5,6-diphenyl-pyrazin-2-amine CAS Name: 2-butoxyacetic acid; N,3-dimethyl-5,6-diphenyl-2-pyrazinamine IUPAC Name: 2-butoxyacetic acid; N,3-dimethyl-5,6-diphenylpyrazin-2-amine Traditional Name: 2-butoxyacetic acid; methyl-(3-methyl-5,6-diphenyl-pyrazin-2-yl)amine Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(=O)O.CC1=NC(=C(N=C1NC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCOCC(=O)O.CC1=NC(=C(N=C1NC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3.C6H12O3/c1-13-18(19-2)21-17(15-11-7-4-8-12-15)16(20-13)14-9-5-3-6-10-14;1-2-3-4-9-5-6(7)8/h3-12H,1-2H3,(H,19,21);2-5H2,1H3,(H,7,8)